methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine

C49H53N3O5S4 — CID 159193456

IUPACmethane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine
SMILESC.COc1ccc2[nH]c(C)cc2c1.COc1ccc2cc(C)sc2c1.COc1ccc2cc(C)sc2n1.COc1ccc2sc(C)cc2c1.COc1cnc2cc(C)sc2c1
InChIInChI=1S/C10H11NO.2C10H10OS.2C9H9NOS.CH4/c1-7-5-8-6-9(12-2)3-4-10(8)11-7;1-7-5-8-6-9(11-2)3-4-10(8)12-7;1-7-5-8-3-4-9(11-2)6-10(8)12-7;1-6-3-8-9(12-6)4-7(11-2)5-10-8;1-6-5-7-3-4-8(11-2)10-9(7)12-6;/h3-6,11H,1-2H3;2*3-6H,1-2H3;2*3-5H,1-2H3;1H4
InChIKeyKOJKNGXVWNAABG-UHFFFAOYSA-N
MW892.25 g/mol
LogP14.78
Rot. Bonds5

About methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine

methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine (PubChem CID 159193456) has the molecular formula C49H53N3O5S4 and a molecular weight of 892.25 g/mol. Its IUPAC name is methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine.

Molecular Properties

Compound Namemethane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine
PubChem CID159193456
Molecular FormulaC49H53N3O5S4
Molecular Weight892.25 g/mol
Exact Mass891.29
IUPAC Namemethane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine
SMILESC.COc1ccc2[nH]c(C)cc2c1.COc1ccc2cc(C)sc2c1.COc1ccc2cc(C)sc2n1.COc1ccc2sc(C)cc2c1.COc1cnc2cc(C)sc2c1
InChIInChI=1S/C10H11NO.2C10H10OS.2C9H9NOS.CH4/c1-7-5-8-6-9(12-2)3-4-10(8)11-7;1-7-5-8-6-9(11-2)3-4-10(8)12-7;1-7-5-8-3-4-9(11-2)6-10(8)12-7;1-6-3-8-9(12-6)4-7(11-2)5-10-8;1-6-5-7-3-4-8(11-2)10-9(7)12-6;/h3-6,11H,1-2H3;2*3-6H,1-2H3;2*3-5H,1-2H3;1H4
InChIKeyKOJKNGXVWNAABG-UHFFFAOYSA-N
XLogP14.78
TPSA87.72 Ų
H-Bond Donors1
H-Bond Acceptors11
Rotatable Bonds5
Heavy Atoms61
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500892.25
LogP ≤ 514.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1011

Analyze methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-methoxy-2-methyl-1,3-benzothiazole;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;2-methoxy-7-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine
CID 157371338
5-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine
CID 158305926
5-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[3,2-b]pyridine
CID 158591338
3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene
CID 159965385
5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine
CID 161401707

Frequently Asked Questions

What is the IUPAC name of methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine?
The IUPAC name of methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine (CID 159193456) is methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine.
What is the SMILES notation for methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine?
The canonical SMILES for methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine is C.COc1ccc2[nH]c(C)cc2c1.COc1ccc2cc(C)sc2c1.COc1ccc2cc(C)sc2n1.COc1ccc2sc(C)cc2c1.COc1cnc2cc(C)sc2c1.
What is the InChIKey of methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine?
The InChIKey is KOJKNGXVWNAABG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO.2C10H10OS.2C9H9NOS.CH4/c1-7-5-8-6-9(12-2)3-4-10(8)11-7;1-7-5-8-6-9(11-2)3-4-10(8)12-7;1-7-5-8-3-4-9(11-2)6-10(8)12-7;1-6-3-8-9(12-6)4-7(11-2)5-10-8;1-6-5-7-3-4-8(11-2)10-9(7)12-6;/h3-6,11H,1-2H3;2*3-6H,1-2H3;2*3-5H,1-2H3;1H4.
What are the key properties of methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine?
methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine has a molecular weight of 892.25 g/mol, XLogP of 14.78, 5 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for methane;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;6-methoxy-2-methylthieno[2,3-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine is sourced from PubChem (CID 159193456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).